0 mol 25 unq 0 iso 0 dist 4.79873 7.19007 7.21175 5.63212 7.44277 11.4211 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 9.3948 14.2706 9.44847 13.086 8.75345 9.05978 numMergedOcc 0
2 mol 95 unq 1 iso 0 dist 9.3948 11.0946 6.05839 13.086 8.75345 6.09655 numMergedOcc 0
3 mol 95 unq 2 iso 0 dist 9.11586 12.7372 9.45222 16.9857 8.75345 10.9887 numMergedOcc 0
4 mol 95 unq 3 iso 0 dist 9.11586 12.7372 9.45222 7.63763 9.79643 11.2065 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 7.7988 5.2438 5.64143 11.0625 6.96745 10.9763 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 9.40824 6.69579 5.64143 14.5726 6.96745 10.9763 numMergedOcc 0
7 mol 112 unq 2 iso 0 dist 4.22363 6.68847 5.64143 9.05551 6.96745 10.9763 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 9.33094 11.0384 6.71328 8.06642 8.62504 13.9713 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.69531 12.3235 6.71328 4.00092 8.62504 13.9713 numMergedOcc 0
10 mol 146 unq 0 iso 0 dist 9.04757 12.9781 6.97799 8.33152 7.78784 10.9932 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.90571 5.88779 7.54492 5.75483 8.5672 9.62603 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 6.61112 4.527 7.54492 10.8286 8.5672 9.62603 numMergedOcc 0
13 mol 197 unq 0 iso 0 dist 9.10817 13.1412 8.53485 9.61454 6.69042 3.57029 numMergedOcc 0
14 mol 197 unq 1 iso 0 dist 6.86828 10.444 8.53485 7.59871 6.69042 3.57029 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 5.23634 6.16261 8.60053 4.664 8.85955 5.78609 numMergedOcc 0
16 mol 227 unq 1 iso 0 dist 5.23634 6.16261 8.60053 4.1511 6.09335 9.11667 numMergedOcc 0
17 mol 227 unq 2 iso 0 dist 6.91318 11.3848 8.60053 8.49509 8.85955 5.78609 numMergedOcc 0
18 mol 227 unq 3 iso 0 dist 6.91318 11.3848 8.60053 4.69247 6.09335 9.11667 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 6.31969 4.01113 5.3725 10.2693 9.02537 11.4899 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 5.13913 9.22087 9.80035 4.40029 4.62936 9.9796 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 6.92711 13.9518 9.80035 3.97543 4.62936 9.9796 numMergedOcc 0
